Octhilinone (OIT)

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Systematic / IUPAC Name: 2-Octyl-1,2-thiazol-3(2H)-one

ID: Reference80

Other Names: 2-Octyl-3-isothiazolone;
2-Octyl-4-isothiazolin-3-one;
2-n-Octyl-4-isothiazolin-3-one;
3(2H)-Isothiazolone, 2-octyl-;
2-Octyl-3(2H)-isothiazolone ; more

Formula: C11H19NOS

Class: Pesticides/Herbicides

Spectral Data

Octhilinone (OIT) mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments LTQ Orbitrap XL; Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 84
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/19/2015 12:27:10 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3
InChI Key JPMIIZHYYWMHDT-UHFFFAOYSA-N
Canonical SMILES CCCCCCCCN1C(=O)C=CS1
CAS 26530201
Splash
Other Names 2-Octyl-3-isothiazolone;
2-Octyl-4-isothiazolin-3-one;
2-n-Octyl-4-isothiazolin-3-one;
3(2H)-Isothiazolone, 2-octyl-;
2-Octyl-3(2H)-isothiazolone;
2-Octylisothiazol-3(2H)-one;
4-Isothiazolin-3-one, 2-octyl-;
Pancil;
Skane 8;
Micro-Check Skane;
Pancil-T;
Kathon LM;
Microbicide M-8;
Micro-chek 11;
Micro-chek 11D;
Skane M-8;
Kathon 893;
Kathon 893F;
Kathon SP 70;
Kathon LP preservative;
Kathon 4200;
Kathon

In Other Databases

ChemIDPlus 026530201
KEGG C18752
ChemSpider 30932
ChEMBL CHEMBL1562104
PubChem 33528
Wikipedia Octhilinon (DE)